SCHEMBL19475763

SCHEMBL19475763

C[Si](C)(C)CCOCOc1cccc(O)c1C(=O)N1C=CCC1C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NFKB1 P19838 3/20 0.33
▸ NFKB2 Q00653 3/20 0.33
▸ RELA Q04206 3/20 0.33
▸ PTPN1 P18031 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19475762 1.00 NFKB1 (0.33) NFKB1NFKB2RELAPTPN1
SCHEMBL19474997 0.94 L3MBTL1 (0.31) —
SCHEMBL19474996 0.94 L3MBTL1 (0.31) —
SCHEMBL19505986 0.91 PTPN1 (0.31) NFKB1NFKB2RELAPTPN1
SCHEMBL19475399 0.90 SMN1; SMN2 (0.37) —
SCHEMBL19475397 0.90 SMN1; SMN2 (0.37) —
SCHEMBL19475398 0.85 NPSR1 (0.38) —
SCHEMBL19475396 0.85 NPSR1 (0.38) —
SCHEMBL19475150 0.81 L3MBTL1 (0.42) —
SCHEMBL19475167 0.80 ALDH1A1 (0.39) —

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10647671-B2 Promysalin analogues and methods of use thereof Temple University—Of the Commonwealth System of Higher Education (US) 2020-05-12 — — US disclosed
US-20190161444-A1 Novel Promysalin Analogues and Methods of Use Thereof Temple University--of the Commonwealth System of Higher Education 2019-05-30 — — US disclosed
WO-2017184558-A1 NOVEL PROMYSALIN ANALOGUES AND METHODS OF USE THEREOF TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2017-10-26 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10647671-B2 Promysalin analogues and methods of use thereof CCL11, MAN2A1, PREP NFKB1 2455/4885NFKB2 2835/4885RELA 1847/4885
US-20190161444-A1 Novel Promysalin Analogues and Methods of Use Thereof MASP2, MAN2A1, CCL11 NFKB1 2723/4885NFKB2 3098/4885RELA 2513/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

Send feedback